N-[(3,4-dimethoxyphenyl)methyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxamide
N-[(3,4-dimethoxyphenyl)methyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxamide
Compound characteristics
| Compound ID: | Y041-4393 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxamide |
| Molecular Weight: | 409.46 |
| Molecular Formula: | C18 H23 N3 O6 S |
| Smiles: | COc1ccc(CNC(C2CCC(N(C3CCS(C3)(=O)=O)N=2)=O)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.3017 |
| logD: | -0.3017 |
| logSw: | -2.2017 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.344 |
| InChI Key: | QOSPSZLEYMCLAU-CYBMUJFWSA-N |